OCC1(CO)CC2C=CC1C2
CAS: 6707-12-6
Name: [2-(hydroxymethyl)-2-bicyclo[2.2.1]hept-5-enyl]methanol
SMILES: OCC1(CO)CC2C=CC1C2

Molecular Processing

Molecular formula
C9H14O2
Molecular weight
154.21
Exact mass
154.0994
XLogP
0.55
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
11
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
41.96

Supplementary Information

InChIKey: DSHXMENPUICESR-UHFFFAOYSA-N
Synonyme
Bicyclo[2.2.1]hept-5-ene-2,2-dimethanolBicyclo(2.2.1)hept-5-ene-2,2-dimethanol4,4-Di(hydroxymethyl)bicyclo(2.2.1)hepteneDTXSID308843304,4-Di(hydroxymethyl)bicyclo[2.2.1]hepteneRefChem:507206DTXCID801021368624-593-65-Norbornene-2,2-dimethanol6707-12-6Bicyclo[2.2.1]hept-5-ene-2,2-diyldimethanol[2-(hydroxymethyl)bicyclo[2.2.1]hept-5-en-2-yl]methanol[2-(hydroxymethyl)-2-bicyclo[2.2.1]hept-5-enyl]methanolMFCD001675952,2-Bis(hydroxymethyl)-5-norbornene5-Norbornene-2.2-dimethanolSCHEMBL4661902,2-bishydroxymethyl-5-norbornene2,2-di-hydroxymethyl-norborn-5-eneSBB060489AKOS003368786AS-65831SY055298DB-003107N0636(Bicyclo[2.2.1]hept-5-ene-2,2-diyl)dimethanolF866127[2-(hydroxymethyl)bicyclo[2.2.1]hept-5-en-2-yl]methan-1-ol5-Norbornene-2,2-dimethanol, inverted exclamation markO98%
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